Vitas-M small molecule compound

2-{5-[(2,6-dichlorobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}pyrazine

Catalog ID
STL339169
SMILES C=CCn1c(nnc1c1cnccn1)SCc1c(Cl)cccc1Cl

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H13Cl2N5S MW 378.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13Cl2N5S/c1-2-8-23-15(14-9-19-6-7-20-14)21-22-16(23)24-10-11-12(17)4-3-5-13(11)18/h2-7,9H,1,8,10H2
InChIKey
RIJVNHPYIWJULR-UHFFFAOYSA-N
Synonyms
676249-54-0
2(4allyl5((26dichlorobenzyl)thio)4H124triazol3yl)pyrazine
2(5(((26DICHLOROPHENYL)METHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)PYRAZINE
2(5((26dichlorobenzyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)pyrazine
2(5((26DICHLOROPHENYL)METHYLSULFANYL)4PROP2ENYL124TRIAZOL3YL)PYRAZINE
3((26DICHLOROPHENYL)METHYLTHIO)4PROP2ENYL5PYRAZIN2YL124TRIAZOLE
676249540
C=CCN1C(=NN=C1SCC2=C(C=CC=C2Cl)Cl)C3=NC=CN=C3
InChI=1SC16H13Cl2N5Sc1282315(14919672014)212216(23)24101112(17)43513(11)18h279H1810H2
MFCD04009247
ZINC000005101008
ZINC05101008
ZINC5101008

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Available files

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